(4Z)-4-[[3-bromanyl-4-(diethylamino)phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[[3-bromanyl-4-(diethylamino)phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-[[3-bromo-4-(diethylamino)phenyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-[[3-bromo-4-(diethylamino)phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-[[3-bromo-4-(diethylamino)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4Z)-4-[3-bromo-4-(diethylamino)benzylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)Br

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)/C=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)Br

InChI

InChI=1S/C21H22BrN3O/c1-4-24(5-2)20-12-11-16(14-19(20)22)13-18-15(3)23-25(21(18)26)17-9-7-6-8-10-17/h6-14H,4-5H2,1-3H3/b18-13-